N-[5-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylcarbonyl)-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[3,4-dihydro-2H-1,5-benzothiazepin-5-yl(oxo)methyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-(3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)-2-methyl-phenyl]-2-furamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCSC3=CC=CC=C32)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCSC3=CC=CC=C32)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H20N2O3S/c1-15-9-10-16(14-17(15)23-21(25)19-7-4-12-27-19)22(26)24-11-5-13-28-20-8-3-2-6-18(20)24/h2-4,6-10,12,14H,5,11,13H2,1H3,(H,23,25)